methyl 3-butyl-6-[3-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-butyl-6-[3-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-butyl-6-[3-[(3-chloro-4-methyl-phenyl)carbamoylamino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[(3-chloro-4-methylanilino)-oxomethyl]amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-butyl-6-[3-[(3-chloro-4-methylphenyl)carbamoylamino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[(3-chloro-4-methyl-phenyl)carbamoylamino]phenyl]-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C25H29ClN4O4 MolecularWeight: 484.97516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl)C(=O)OC)C

InChI

InChI=1S/C25H29ClN4O4/c1-5-6-12-30-16(3)21(23(31)34-4)22(29-25(30)33)17-8-7-9-18(13-17)27-24(32)28-19-11-10-15(2)20(26)14-19/h7-11,13-14,22H,5-6,12H2,1-4H3,(H,29,33)(H2,27,28,32)